N-[2-azanyl-3-(4-hydroxyphenyl)propanoyl]-5-[1-(4-tert-butylphenyl)-5-pyridin-3-yl-pyrazol-3-yl]pentanamide

Systemtic Name: N-[2-azanyl-3-(4-hydroxyphenyl)propanoyl]-5-[1-(4-tert-butylphenyl)-5-pyridin-3-yl-pyrazol-3-yl]pentanamide Openeye Name: N-[2-amino-3-(4-hydroxyphenyl)propanoyl]-5-[1-(4-tert-butylphenyl)-5-(3-pyridyl)pyrazol-3-yl]pentanamide CAS Name: N-[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]-5-[1-(4-tert-butylphenyl)-5-(3-pyridinyl)-3-pyrazolyl]pentanamide IUPAC Name: N-[2-amino-3-(4-hydroxyphenyl)propanoyl]-5-[1-(4-tert-butylphenyl)-5-pyridin-3-ylpyrazol-3-yl]pentanamide Traditional Name: 5-[1-(4-tert-butylphenyl)-5-(3-pyridyl)pyrazol-3-yl]-N-tyrosyl-valeramide Formula: C32H37N5O3 MolecularWeight: 539.66788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C(=CC(=N2)CCCCC(=O)NC(=O)C(CC3=CC=C(C=C3)O)N)C4=CN=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C(=CC(=N2)CCCCC(=O)NC(=O)C(CC3=CC=C(C=C3)O)N)C4=CN=CC=C4

InChI

InChI=1S/C32H37N5O3/c1-32(2,3)24-12-14-26(15-13-24)37-29(23-7-6-18-34-21-23)20-25(36-37)8-4-5-9-30(39)35-31(40)28(33)19-22-10-16-27(38)17-11-22/h6-7,10-18,20-21,28,38H,4-5,8-9,19,33H2,1-3H3,(H,35,39,40)